N-[1-(5-cyclopropyl-2-pyridinyl)-3-(4-methylpiperazin-1-yl)pyrazol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C23H25N9O — CID 66556462

IUPACN-[1-(5-cyclopropyl-2-pyridinyl)-3-(4-methylpiperazin-1-yl)pyrazol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCN1CCN(c2cc(NC(=O)c3cnn4cccnc34)n(-c3ccc(C4CC4)cn3)n2)CC1
InChIInChI=1S/C23H25N9O/c1-29-9-11-30(12-10-29)21-13-20(27-23(33)18-15-26-31-8-2-7-24-22(18)31)32(28-21)19-6-5-17(14-25-19)16-3-4-16/h2,5-8,13-16H,3-4,9-12H2,1H3,(H,27,33)
InChIKeyMDOOYOLKJFRCAI-UHFFFAOYSA-N
MW443.52 g/mol
LogP2.19
Rot. Bonds5

About N-[1-(5-cyclopropyl-2-pyridinyl)-3-(4-methylpiperazin-1-yl)pyrazol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

N-[1-(5-cyclopropyl-2-pyridinyl)-3-(4-methylpiperazin-1-yl)pyrazol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 66556462) has the molecular formula C23H25N9O and a molecular weight of 443.52 g/mol. Its IUPAC name is N-[1-(5-cyclopropyl-2-pyridinyl)-3-(4-methylpiperazin-1-yl)pyrazol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(5-cyclopropyl-2-pyridinyl)-3-(4-methylpiperazin-1-yl)pyrazol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID66556462
Molecular FormulaC23H25N9O
Molecular Weight443.52 g/mol
Exact Mass443.22
IUPAC NameN-[1-(5-cyclopropyl-2-pyridinyl)-3-(4-methylpiperazin-1-yl)pyrazol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCN1CCN(c2cc(NC(=O)c3cnn4cccnc34)n(-c3ccc(C4CC4)cn3)n2)CC1
InChIInChI=1S/C23H25N9O/c1-29-9-11-30(12-10-29)21-13-20(27-23(33)18-15-26-31-8-2-7-24-22(18)31)32(28-21)19-6-5-17(14-25-19)16-3-4-16/h2,5-8,13-16H,3-4,9-12H2,1H3,(H,27,33)
InChIKeyMDOOYOLKJFRCAI-UHFFFAOYSA-N
XLogP2.19
TPSA96.48 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.52
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze N-[1-(5-cyclopropyl-2-pyridinyl)-3-(4-methylpiperazin-1-yl)pyrazol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-cyclopropyl-2-pyridinyl)-3-(4-methylpiperazin-1-yl)pyrazol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-[1-(5-cyclopropyl-2-pyridinyl)-3-(4-methylpiperazin-1-yl)pyrazol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 66556462) is N-[1-(5-cyclopropyl-2-pyridinyl)-3-(4-methylpiperazin-1-yl)pyrazol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-[1-(5-cyclopropyl-2-pyridinyl)-3-(4-methylpiperazin-1-yl)pyrazol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-[1-(5-cyclopropyl-2-pyridinyl)-3-(4-methylpiperazin-1-yl)pyrazol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is CN1CCN(c2cc(NC(=O)c3cnn4cccnc34)n(-c3ccc(C4CC4)cn3)n2)CC1.
What is the InChIKey of N-[1-(5-cyclopropyl-2-pyridinyl)-3-(4-methylpiperazin-1-yl)pyrazol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is MDOOYOLKJFRCAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N9O/c1-29-9-11-30(12-10-29)21-13-20(27-23(33)18-15-26-31-8-2-7-24-22(18)31)32(28-21)19-6-5-17(14-25-19)16-3-4-16/h2,5-8,13-16H,3-4,9-12H2,1H3,(H,27,33).
What are the key properties of N-[1-(5-cyclopropyl-2-pyridinyl)-3-(4-methylpiperazin-1-yl)pyrazol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-[1-(5-cyclopropyl-2-pyridinyl)-3-(4-methylpiperazin-1-yl)pyrazol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 443.52 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-cyclopropyl-2-pyridinyl)-3-(4-methylpiperazin-1-yl)pyrazol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 66556462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).